Geometry & MOs

Info

ID:	35505
PubChem CID:	7979960
Reduced:	N2O2C11H11 (2)
Stoich.:	A2B2C11D11 (2)
Weight, g/mol:	404.11207
ΔH_f, kcal/mol:	-73.97
Dipole, Da:	3.15
IP(EA), eV:	-8.89(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-oxo-N'-(2-oxochromene-3-carbonyl)phthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)COC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations